N-methyl-N-[2-(4-propylphenyl)ethyl]azetidin-3-amine

C15H24N2 — CID 117040771

IUPACN-methyl-N-[2-(4-propylphenyl)ethyl]azetidin-3-amine
SMILESCCCc1ccc(CCN(C)C2CNC2)cc1
InChIInChI=1S/C15H24N2/c1-3-4-13-5-7-14(8-6-13)9-10-17(2)15-11-16-12-15/h5-8,15-16H,3-4,9-12H2,1-2H3
InChIKeyHECFUACBWMTJHS-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.09
Rot. Bonds6

About N-methyl-N-[2-(4-propylphenyl)ethyl]azetidin-3-amine

N-methyl-N-[2-(4-propylphenyl)ethyl]azetidin-3-amine (PubChem CID 117040771) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is N-methyl-N-[2-(4-propylphenyl)ethyl]azetidin-3-amine.

Molecular Properties

Compound NameN-methyl-N-[2-(4-propylphenyl)ethyl]azetidin-3-amine
PubChem CID117040771
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC NameN-methyl-N-[2-(4-propylphenyl)ethyl]azetidin-3-amine
SMILESCCCc1ccc(CCN(C)C2CNC2)cc1
InChIInChI=1S/C15H24N2/c1-3-4-13-5-7-14(8-6-13)9-10-17(2)15-11-16-12-15/h5-8,15-16H,3-4,9-12H2,1-2H3
InChIKeyHECFUACBWMTJHS-UHFFFAOYSA-N
XLogP2.09
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(4-methoxyphenyl)ethyl]-N-methylazetidin-3-amine
CID 66187359
N-methyl-N-[2-(4-methylsulfanylphenyl)ethyl]azetidin-3-amine
CID 117040828
N-methyl-N-(4-propylphenyl)pyrrolidin-3-amine
CID 115118684
N-[2-(1,3-benzodioxol-5-yl)ethyl]-N-methylazetidin-3-amine
CID 117040773
ethane;N-methyl-N-propylazetidin-3-amine
CID 144899605
N-propyl-N-[1-(4-propylphenyl)ethyl]azetidin-3-amine
CID 66183935
N-[2-(4-ethylphenyl)ethyl]-N-methylpiperidin-4-amine
CID 115118500
N-heptyl-N-methylazetidin-3-amine
CID 66185882
N-methyl-N-nonylazetidin-3-amine
CID 66186670
N-ethyl-N-(2-phenylethyl)azetidin-3-amine
CID 66182276
N-[2-(4-methoxyphenyl)ethyl]-N-methylpiperidin-3-amine
CID 63642664
N-methyl-4-propyl-N-pyrrolidin-3-ylbenzenesulfonamide
CID 55136438

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-(4-propylphenyl)ethyl]azetidin-3-amine?
The IUPAC name of N-methyl-N-[2-(4-propylphenyl)ethyl]azetidin-3-amine (CID 117040771) is N-methyl-N-[2-(4-propylphenyl)ethyl]azetidin-3-amine.
What is the SMILES notation for N-methyl-N-[2-(4-propylphenyl)ethyl]azetidin-3-amine?
The canonical SMILES for N-methyl-N-[2-(4-propylphenyl)ethyl]azetidin-3-amine is CCCc1ccc(CCN(C)C2CNC2)cc1.
What is the InChIKey of N-methyl-N-[2-(4-propylphenyl)ethyl]azetidin-3-amine?
The InChIKey is HECFUACBWMTJHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-3-4-13-5-7-14(8-6-13)9-10-17(2)15-11-16-12-15/h5-8,15-16H,3-4,9-12H2,1-2H3.
What are the key properties of N-methyl-N-[2-(4-propylphenyl)ethyl]azetidin-3-amine?
N-methyl-N-[2-(4-propylphenyl)ethyl]azetidin-3-amine has a molecular weight of 232.37 g/mol, XLogP of 2.09, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-(4-propylphenyl)ethyl]azetidin-3-amine is sourced from PubChem (CID 117040771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).